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Home Nitro Compounds 331459-59-7
331459-59-7,MFCD00169082
Catalog No.:AA00ISQM

331459-59-7 | 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-nitrophenyl)acetamide

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Technical Information
Catalog Number:
AA00ISQM
Chemical Name:
2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
CAS Number:
331459-59-7
Molecular Formula:
C11H11N5O3S
Molecular Weight:
293.3017
MDL Number:
MFCD00169082
SMILES:
O=C(Nc1cccc(c1)[N+](=O)[O-])CSc1nncn1C
Properties
Computed Properties
 
Complexity:
365  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
1  

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Additional Info:
SDS
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Tags:331459-59-7 Molecular Formula|331459-59-7 MDL|331459-59-7 SMILES|331459-59-7 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-nitrophenyl)acetamide